Information card for entry 4000105

Structure parameters

• Formula: B Fe H5 N O9 P2
• Calculated formula: B Fe H5 N O9 P2
• Journal of publication: Chemistry of Materials
• Year of publication: 2001
• a: 9.3698 ± 0.0011 Å
• b: 8.3092 ± 0.0015 Å
• c: 9.68 ± 0.001 Å
• α: 90°
• β: 102.049 ± 0.013°
• γ: 90°
• Cell volume: 737.04 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0891
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0596
• Weighted residual factors for all reflections included in the refinement: 0.0674
• Goodness-of-fit parameter for all reflections included in the refinement: 0.864
• Diffraction radiation wavelength: 0.56087 Å
• Diffraction radiation type: AgKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No